D577-0009 Screening compound: 3-(2,3-dimethylphenyl)-1-(4-{[2-(ethylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea

D577-0009 Screening compound: 3-(2,3-dimethylphenyl)-1-(4-{[2-(ethylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea
D577-0009 Screening compound: 3-(2,3-dimethylphenyl)-1-(4-{[2-(ethylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound D577-0009
3-(2,3-dimethylphenyl)-1-(4-{[2-(ethylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

D577-0009

Molecular Formula

C22H26N6O (C22 H26 N6 O)

Compound Name

3-(2,3-dimethylphenyl)-1-(4-{[2-(ethylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea

IUPAC name

3-(23-dimethylphenyl)-1-(4-{[2-(ethylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea

SMILES

CCNc1nc(C)cc(Nc(cc2)ccc2NC(Nc2c(C)c(C)ccc2)=O)n1

InChI

InChI=1S/C22H26N6O/c1-5-23-21-24-15(3)13-20(28-21)25-17-9-11-18(12-10-17)26-22(29)27-19-8-6-7-14(2)16(19)4/h6-13H,5H2,1-4H3,(H2,26,27,29)(H2,23,24,25,28)

InChI Key

DSEVZRMRPNAFTN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD21610927

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.377

Distribution Coefficient, logD

4.294

Water Solubility, LogSw

-5.35

Polar Surface Area

70.967

Acid Dissociation Constant (pKa)

13.57

Base Dissociation Constant (pKb)

8.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

D577-0009 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with D577-0009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D577-0009?
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What is the minimum amount of D577-0009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D577-0009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D577-0009
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of D577-0009 available by request